Vitas-M small molecule compound
2-{[8-(3-chlorophenyl)-2,3,4,8-tetrahydropyrazolo[4,3-e]pyrimido[1,2-c]pyrimidin-6-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Catalog ID
STK640757
SMILES O=C(Nc1ccc(cc1)F)CSc1nc2c(c3=NCCCn13)cnn2c1cccc(c1)Cl
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H18ClFN6OS MW 468.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClFN6OS/c23-14-3-1-4-17(11-14)30-21-18(12-26-30)20-25-9-2-10-29(20)22(28-21)32-13-19(31)27-16-7-5-15(24)6-8-16/h1,3-8,11-12H,2,9-10,13H2,(H,27,31)InChIKey
QUKDXVSKMPWZMQ-UHFFFAOYSA-NSynonyms
1010916-85-41010916854
2((8(3chlorophenyl)2348tetrahydropyrazolo(43e)pyrimido(12c)pyrimidin6yl)sulfanyl)N(4fluorophenyl)acetamide
2((8(3chlorophenyl)2348tetrahydropyrazolo(43e)pyrimido(12c)pyrimidin6yl)thio)N(4fluorophenyl)acetamide
C1CN=C2C3=C(N=C(N2C1)SCC(=O)NC4=CC=C(C=C4)F)N(N=C3)C5=CC(=CC=C5)Cl
InChI=1SC22H18ClFN6OSc231431417(1114)302118(122630)2025921029(20)22(2821)321319(31)27167515(24)6816h1381112H291013H2(H2731)
MFCD12204112
ZINC000012408452
ZINC12408452
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